SCHEMBL21590147

SCHEMBL21590147

NNC(=O)c1ccccc1Oc1ccc(F)cc1F

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.54
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
PNLIP P16233 1/20 0.47
SCN8A Q9UQD0 4/20 0.45
SCN10A Q9Y5Y9 4/20 0.45
CARM1 Q86X55 3/20 0.44
PRMT6 Q96LA8 2/20 0.44
KDM4E B2RXH2 1/20 0.43
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6329484 0.84 CTSD (0.72) CTSDMEN1KMT2ANPSR1TDP1
SCHEMBL11857021 0.81 HTT (0.56) PNLIPKDM4ETSHRNPSR1TDP1
SCHEMBL11860422 0.81 SLC6A3 (0.55) MEN1KMT2APNLIPKDM4ETSHR
SCHEMBL10555371 0.78 SRC (0.47) PNLIPKDM4ETSHRNPSR1TDP1
SCHEMBL108531 0.76 CES2 (0.61) KDM4EL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL3650651 0.74 MEN1 (0.69) CTSDMEN1KMT2AKDM4ETSHR
SCHEMBL28581414 0.73 SMN1; SMN2 (0.51) MEN1KMT2AKDM4ETDP1L3MBTL1
SCHEMBL10456772 0.73 TRPA1 (0.56)
SCHEMBL2564034 0.72 CTSD (0.70) CTSDMEN1KMT2ATDP1NPC1
SCHEMBL246382 0.72 CES2 (0.61) CTSDMEN1KMT2AKDM4ETDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110914261-B Oxadiazole oxime derivative and application thereof in agriculture 东莞市东阳光农药研发有限公司 2020-11-24 CN disclosed
WO-2019238095-A1 OXADIAZOLE OXIME DERIVATIVE AND USE THEREOF IN AGRICULTURE 东莞市东阳光农药研发有限公司 2019-12-19 WO disclosed